%chk=000298321.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298321

0 1
O 0.872616 1.265766 0.221086
N -0.905488 -0.563533 -0.942271
C -1.580608 -0.653722 0.394084
C 0.548640 -0.840360 -0.859933
C -3.025246 -0.241276 0.244482
C 1.383137 0.237136 -0.172351
C 2.842315 -0.027526 0.010658
C -3.531805 0.832864 0.989700
C -3.869114 -0.940368 -0.632015
C 3.516268 -1.058417 -0.660105
C 3.552826 0.808689 0.888263
C -4.876087 1.196436 0.865708
C -5.210490 -0.570700 -0.754697
C -5.717122 0.495834 -0.004151
C 4.883303 -1.254205 -0.448230
C 4.918709 0.608829 1.101400
C 5.584376 -0.423559 0.433434
H -1.072440 -0.038947 1.172679
H -1.529542 -1.712098 0.739017
H 0.710132 -1.821792 -0.357706
H 0.910216 -0.973907 -1.908829
H -1.050151 0.382887 -1.324190
H -2.880710 1.388919 1.662105
H -3.466937 -1.763338 -1.223065
H 2.987191 -1.710761 -1.354124
H 3.022978 1.619691 1.397622
H -5.266815 2.029622 1.446973
H -5.862274 -1.113610 -1.436648
H -6.762511 0.780763 -0.099181
H 5.404697 -2.054533 -0.971345
H 5.463532 1.258908 1.784727
H 6.650404 -0.580792 0.597403


%chk=000298321-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298321

0 1
O 1.069141 1.492858 0.149564
N -0.869767 -0.269077 -0.887303
C -1.576846 -0.301845 0.416273
C 0.536737 -0.669595 -0.850113
C -3.080561 -0.106338 0.248868
C 1.501095 0.351991 -0.189808
C 2.942686 -0.021664 0.006962
C -3.815587 0.641480 1.202066
C -3.771280 -0.691826 -0.842841
C 3.465422 -1.280691 -0.398386
C 3.811620 0.924850 0.616950
C -5.216406 0.790750 1.078209
C -5.169684 -0.540397 -0.971543
C -5.898645 0.198726 -0.009509
C 4.828901 -1.584128 -0.196131
C 5.171357 0.619935 0.820710
C 5.683629 -0.636481 0.413988
H -1.187295 0.448699 1.140224
H -1.385967 -1.302313 0.859240
H 0.617008 -1.641471 -0.324168
H 0.898981 -0.846352 -1.884595
H -0.991714 0.644238 -1.345596
H -3.288808 1.112359 2.041738
H -3.192141 -1.250577 -1.585871
H 2.818397 -2.025693 -0.873196
H 3.390469 1.889587 0.919524
H -5.771488 1.372737 1.822958
H -5.692283 -0.997465 -1.820060
H -6.983769 0.316421 -0.109687
H 5.225872 -2.555023 -0.511910
H 5.833341 1.354018 1.292812
H 6.741585 -0.874813 0.571131


